2-amino-1-[(E)-ethylideneamino]-3-(methylideneamino)guanidine

C4H10N6 — CID 173495216

IUPAC2-amino-1-[(E)-ethylideneamino]-3-(methylideneamino)guanidine
SMILESC=NNC(=NN)N/N=C/C
InChIInChI=1S/C4H10N6/c1-3-7-10-4(8-5)9-6-2/h3H,2,5H2,1H3,(H2,8,9,10)/b7-3+
InChIKeyJAFQZMWRCUZFPF-XVNBXDOJSA-N
MW142.17 g/mol
LogP-0.98
Rot. Bonds2

About 2-amino-1-[(E)-ethylideneamino]-3-(methylideneamino)guanidine

2-amino-1-[(E)-ethylideneamino]-3-(methylideneamino)guanidine (PubChem CID 173495216) has the molecular formula C4H10N6 and a molecular weight of 142.17 g/mol. Its IUPAC name is 2-amino-1-[(E)-ethylideneamino]-3-(methylideneamino)guanidine.

Molecular Properties

Compound Name2-amino-1-[(E)-ethylideneamino]-3-(methylideneamino)guanidine
PubChem CID173495216
Molecular FormulaC4H10N6
Molecular Weight142.17 g/mol
Exact Mass142.10
IUPAC Name2-amino-1-[(E)-ethylideneamino]-3-(methylideneamino)guanidine
SMILESC=NNC(=NN)N/N=C/C
InChIInChI=1S/C4H10N6/c1-3-7-10-4(8-5)9-6-2/h3H,2,5H2,1H3,(H2,8,9,10)/b7-3+
InChIKeyJAFQZMWRCUZFPF-XVNBXDOJSA-N
XLogP-0.98
TPSA87.16 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.17
LogP ≤ 5-0.98
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-amino-1-[(E)-ethylideneamino]-3-(methylideneamino)guanidine?
The IUPAC name of 2-amino-1-[(E)-ethylideneamino]-3-(methylideneamino)guanidine (CID 173495216) is 2-amino-1-[(E)-ethylideneamino]-3-(methylideneamino)guanidine.
What is the SMILES notation for 2-amino-1-[(E)-ethylideneamino]-3-(methylideneamino)guanidine?
The canonical SMILES for 2-amino-1-[(E)-ethylideneamino]-3-(methylideneamino)guanidine is C=NNC(=NN)N/N=C/C.
What is the InChIKey of 2-amino-1-[(E)-ethylideneamino]-3-(methylideneamino)guanidine?
The InChIKey is JAFQZMWRCUZFPF-XVNBXDOJSA-N. The full InChI is InChI=1S/C4H10N6/c1-3-7-10-4(8-5)9-6-2/h3H,2,5H2,1H3,(H2,8,9,10)/b7-3+.
What are the key properties of 2-amino-1-[(E)-ethylideneamino]-3-(methylideneamino)guanidine?
2-amino-1-[(E)-ethylideneamino]-3-(methylideneamino)guanidine has a molecular weight of 142.17 g/mol, XLogP of -0.98, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-1-[(E)-ethylideneamino]-3-(methylideneamino)guanidine is sourced from PubChem (CID 173495216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).